Geometry & MOs

Info

ID:	392900
PubChem CID:	135018356
Reduced:	SN3O4H23C26 (1)
Stoich.:	AB3C4D23E26 (1)
Weight, g/mol:	262.141638
ΔH_f, kcal/mol:	-75.9
Dipole, Da:	6.86
IP(EA), eV:	-8.54(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4S)-4-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

Drug info:

PubChemData

Smile

CCN1C2=C(C3=C(C=C2)N(C(=O)C=C3)C)N(C4=CC=CC=C4C1=O)S(=O)(=O)C5=CC=C(C=C5)C

DOS

IR

Vibrations